Mrv1652309052203072D 11 11 0 0 0 0 999 V2000 1.2822 2.3518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5678 1.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5678 1.1143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2352 0.6294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9803 -0.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4652 -0.8227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1553 -0.1553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0997 0.6294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8843 0.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0558 1.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8405 1.9462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 3 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 M END > NP0205261 > NP-MRD > OC\C=C1\OC(=O)C=C1C=O > InChI=1S/C7H6O4/c8-2-1-6-5(4-9)3-7(10)11-6/h1,3-4,8H,2H2/b6-1+ > OHUSAELEYQKLFV-LZCJLJQNSA-N > C7H6O4 > 154.121 > 154.026608673 > 3 > 17 > 13.939682865785056 > 1 > 1 > 0 > 0 > (2E)-2-(2-hydroxyethylidene)-5-oxo-2,5-dihydrofuran-3-carbaldehyde > -0.860877133 > 0 > 1 > 0 > 15.50145279141346 > -2.5794645490357526 > 63.60000000000001 > 38.53210000000001 > 2 > 1 > (2E)-2-(2-hydroxyethylidene)-5-oxofuran-3-carbaldehyde > 0 > NP0205261 > (2e)-2-(2-hydroxyethylidene)-5-oxofuran-3-carbaldehyde $$$$